1H0T
An affibody in complex with a target protein: structure and coupled folding
SOLUTION NMR
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | Avance | 500 |
| 2 | Bruker | Avance | 600 |
| 3 | Varian | INOVA | 800 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| SIMULATED ANEALING | REFINEMENT DETAILS CAN BE FOUND IN THE JRNL CITATION ABOVE. | X-PLOR_NIH |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | LEAST RESTRAINT VIOLATION AND GOOD RAMACHANDRAN PLOTS |
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 40 |
| Representative Model | 1 (n/a) |
| Additional NMR Experimental Information | |
|---|---|
| Details | THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR SPECTROSCOPY ON 13C, 15N-LABELED PROTEINS. ONE OF THE SUBUNITS WAS LABELED THE OTHER SUBUNIT WAS KEPT UNLABELED. |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | refinement | X-PLOR_NIH | BRUNGER | |
| 2 | structure solution | XWIN-NMR | ||
| 3 | structure solution | NMR-PIPE | ||
| 4 | structure solution | ANSIG FOR WINDOWS | WINDOWS | |
| 5 | structure solution | XPLOR | ||
